Compound Identification
SMILES
CC(C)N1CCC2=C(C1)SC1=C2C2=NC(CSC3=NC4=CC=CC=C4O3)=NN2C=N1
InChIKey
InChIKey=OICOWFDJQOCDTC-UHFFFAOYSA-N
Formula
C21H20N6OS2
Mass
436.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Triazolopyrimidines
Alternative Parents
Benzoxazoles Thienopyrimidines Aralkylamines Alkylarylthioethers Pyrimidines and pyrimidine derivatives Benzenoids Thiophenes Oxazoles Heteroaromatic compounds Triazoles Trialkylamines Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Thienopyrimidine - Triazolopyrimidine - Aryl thioether - Alkylarylthioether - Aralkylamine - Pyrimidine - Benzenoid - Azole - Oxazole - Thiophene - Triazole - 1,2,4-triazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Thioether - Sulfenyl compound - Oxacycle - Azacycle - Amine - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available